| SpectraBase Spectrum ID |
A84AlYWhtjY |
| Name |
Diisopropyl 8-hydroxy-5,5-dimethyl-5,10B-dihydro-1H-chromeno[4,3-C]pyridazine-1,2(3H)-dicarboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
404.194736624 u |
| Formula |
C21H28N2O6 |
| InChI |
InChI=1S/C21H28N2O6/c1-12(2)27-19(25)22-10-9-16-18(23(22)20(26)28-13(3)4)15-8-7-14(24)11-17(15)29-21(16,5)6/h7-9,11-13,18,24H,10H2,1-6H3 |
| InChIKey |
WHYIACMNPAAICZ-UHFFFAOYSA-N |
| Molecular Weight |
404.463 g/mol |
| SMILES |
CC1(C)OC=2C(C3C1=CCN(N3C(=O)OC(C)C)C(OC(C)C)=O)=CC=C(O)C2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.885096 |
![Diisopropyl 8-hydroxy-5,5-dimethyl-5,10b-dihydro-1H-chromeno[4,3-c]pyridazine-1,2(3H)-dicarboxylate](/api/spectrum/A84AlYWhtjY/structure.png?h=300&w=458 "Diisopropyl 8-hydroxy-5,5-dimethyl-5,10b-dihydro-1H-chromeno[4,3-c]pyridazine-1,2(3H)-dicarboxylate")
